[2-[3-(4-hydroxyphenyl)butyl]-3-oxidanyl-phenyl]sulfanylphosphonic acid

Systemtic Name: [2-[3-(4-hydroxyphenyl)butyl]-3-oxidanyl-phenyl]sulfanylphosphonic acid Openeye Name: [3-hydroxy-2-[3-(4-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid CAS Name: [[3-hydroxy-2-[3-(4-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid IUPAC Name: [3-hydroxy-2-[3-(4-hydroxyphenyl)butyl]phenyl]sulfanylphosphonic acid Traditional Name: [[3-hydroxy-2-[3-(4-hydroxyphenyl)butyl]phenyl]thio]phosphonic acid Formula: C16H19O5PS MolecularWeight: 354.357821

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=CC=C1SP(=O)(O)O)O)C2=CC=C(C=C2)O

Isomeric SMILES

CC(CCC1=C(C=CC=C1SP(=O)(O)O)O)C2=CC=C(C=C2)O

InChI

InChI=1S/C16H19O5PS/c1-11(12-6-8-13(17)9-7-12)5-10-14-15(18)3-2-4-16(14)23-22(19,20)21/h2-4,6-9,11,17-18H,5,10H2,1H3,(H2,19,20,21)